Glycoside
GD152083
Name:
Gaudimycin EFormula:
C37H47O13NSmiles:
CC1OC(OC(C)(CC(=O)O)Cc2ccc3c(c2O)C(=O)c2ccc(C4CCC(OC5CC(O)C(O)C(C)O5)C(C)O4)c(O)c2C3=O)CCC1NAglycone:
CC1OC(OC(C)(CC(=O)O)Cc2ccc3c(c2O)C(=O)c2ccc(C4CCC(O)C(C)O4)c(O)c2C3=O)CCC1NSugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.59 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 9 |
| MolWt: | 713.78 | Num_heavy_atoms: | 51 |
| TPSA: | 224.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD60585
Formula: C31H37O10N
Smiles:
CC1OC(OC(C)(CC(=O)O)Cc2ccc3c(c2O)C(=O)c2ccc(C4CCC(O)C(C)O4)c(O)c2C3=O)CCC1N| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.52 |
| AlogP: | 3.12 | Num_rotatable_bonds: | 7 |
| MolWt: | 583.63 | Num_heavy_atoms: | 42 |
| TPSA: | 185.84 | NumAromaticRings: | 2 |
